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Diethyl [dibromo(fluoro)methyl]phosphonate
TL;DR: Diethyl [dibromo(fluoro)methyl]phosphonate (CAS 65094-25-9) is a chemical compound with molecular formula C5H10Br2FO3P and molecular weight 325.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[dibromo(fluoro)methyl]-ethoxyphosphoryl]oxyethane
Also Known As: Diethyl [dibromo(fluoro)methyl]phosphonate, (EtO)2P(O)CFBr2, Diethyl (dibromofluoromethyl)phosphonate, 1-[[dibromo(fluoro)methyl]-ethoxyphosphoryl]oxyethane, diethyl dibromo(fluoro)methylphosphonate
| Molecular Formula | C5H10Br2FO3P |
|---|---|
| Molecular Weight | 325.87 g/mol |
| LogP | 3.6231 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.87183 |
| Heavy Atoms | 12 |
| Complexity | 172.02237 |
Chemical Identifiers
| CAS Number | 65094-25-9 |
|---|---|
| SMILES | CCOP(=O)(C(F)(Br)Br)OCC |
Product Overview
Diethyl [dibromo(fluoro)methyl]phosphonate (CAS 65094-25-9), with molecular formula C5H10Br2FO3P and molecular weight 325.87 g/mol. IUPAC: 1-[[dibromo(fluoro)methyl]-ethoxyphosphoryl]oxyethane.
Chemical Property Profile of Diethyl [dibromo(fluoro)methyl]phosphonate
Property Insights of Diethyl [dibromo(fluoro)methyl]phosphonate
The XLogP value of 3.6231 indicates that Diethyl [dibromo(fluoro)methyl]phosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Diethyl [dibromo(fluoro)methyl]phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl [dibromo(fluoro)methyl]phosphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl [dibromo(fluoro)methyl]phosphonate?
The CAS number of Diethyl [dibromo(fluoro)methyl]phosphonate is 65094-25-9.
What is the molecular formula of Diethyl [dibromo(fluoro)methyl]phosphonate?
The molecular formula of Diethyl [dibromo(fluoro)methyl]phosphonate is C5H10Br2FO3P.
What is the molecular weight of Diethyl [dibromo(fluoro)methyl]phosphonate?
The molecular weight of Diethyl [dibromo(fluoro)methyl]phosphonate is 325.87 g/mol.
Where can I buy Diethyl [dibromo(fluoro)methyl]phosphonate?
You can request a quote for Diethyl [dibromo(fluoro)methyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl [dibromo(fluoro)methyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl [dibromo(fluoro)methyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.